TL;DR: 6,12'-Dimethoxy-2,2'-dimethyl-6',7-epoxyoxyacanthan (CAS 26195-62-0) is a chemical compound with molecular formula C36H36N2O5 and molecular weight 576.26245 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
13,27-dimethoxy-7,22-dimethyl-15,29,31-trioxa-7,22-diazaoctacyclo[19.9.3.216,19.14,30.110,14.03,8.025,33.028,32]heptatriaconta-1(30),2,4(34),10(37),11,13,16,18,25,27,32,35-dodecaene
Also Known As: Homotrilobine, Homotrilobin, Isotrilobin, N,O-Dimethylcocsoline, ISOTRILOBINE
| Molecular Formula | C36H36N2O5 |
| Molecular Weight | 576.26245 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 576.26245 Da |
| Heavy Atoms | 43 |
| Complexity | 960.0 |
| SMILES | CN1CCC2=CC(=C3C4=C2C1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)CC7C8=CC(=C(O3)C=C8CCN7C)O4)OC)OC |
| InChIKey | SVMNNRZZJAFEJM-UHFFFAOYSA-N |
The XLogP value of 6.3 indicates that 6,12'-Dimethoxy-2,2'-dimethyl-6',7-epoxyoxyacanthan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 6,12'-Dimethoxy-2,2'-dimethyl-6',7-epoxyoxyacanthan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,12'-Dimethoxy-2,2'-dimethyl-6',7-epoxyoxyacanthan has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 6,12'-Dimethoxy-2,2'-dimethyl-6',7-epoxyoxyacanthan is 26195-62-0.
The molecular formula of 6,12'-Dimethoxy-2,2'-dimethyl-6',7-epoxyoxyacanthan is C36H36N2O5.
The molecular weight of 6,12'-Dimethoxy-2,2'-dimethyl-6',7-epoxyoxyacanthan is 576.26245 g/mol.
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